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Substance Name: Roseoflavin
RN: 51093-55-1
InChIKey: IGQLDUYTWDABFK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N5-O6

Molecular Weight

  • 405.4087
 
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Names and Synonyms

Name of Substance

  • Roseoflavin

Synonyms

  • Roseoflavin
  • Roseoflavine

Systematic Name

  • Riboflavin, 8-demethyl-8-(dimethylamino)-

Registry Numbers

CAS Registry Number

  • 51093-55-1

System Generated Number

  • 0051093551

Structure Descriptors

InChI

1S/C18H23N5O6/c1-8-4-9-11(5-10(8)22(2)3)23(6-12(25)15(27)13(26)7-24)16-14(19-9)17(28)21-18(29)20-16/h4-5,12-13,15,24-27H,6-7H2,1-3H3,(H,21,28,29)

InChIKey

IGQLDUYTWDABFK-UHFFFAOYSA-N

Smiles

Cc1cc2c(cc1N(C)C)n(c-3nc(=O)[nH]c(=O)c3n2)CC(C(C(CO)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Antibiotics. Vol. 27, Pg. 88, 1974.
mouse LD50 oral 3gm/kg (3000mg/kg)   "Antibiotics: Origin, Nature, and Properties," Korzyoski, T., et al., eds., Washington, DC, American Soc. for Microbiology, 1978Vol. 1, Pg. 277, 1978.